4-[6,8-bis(fluoranyl)-7-hexyl-9,10-dihydrophenanthren-2-yl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[6,8-bis(fluoranyl)-7-hexyl-9,10-dihydrophenanthren-2-yl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-(6,8-difluoro-7-hexyl-9,10-dihydrophenanthren-2-yl)-2-fluoro-benzonitrile CAS Name: 4-(6,8-difluoro-7-hexyl-9,10-dihydrophenanthren-2-yl)-2-fluorobenzonitrile IUPAC Name: 4-(6,8-difluoro-7-hexyl-9,10-dihydrophenanthren-2-yl)-2-fluorobenzonitrile Traditional Name: 4-(6,8-difluoro-7-hexyl-9,10-dihydrophenanthren-2-yl)-2-fluoro-benzonitrile Formula: C27H24F3N MolecularWeight: 419.48137

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1F)CCC3=C2C=CC(=C3)C4=CC(=C(C=C4)C#N)F)F

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1F)CCC3=C2C=CC(=C3)C4=CC(=C(C=C4)C#N)F)F

InChI

InChI=1S/C27H24F3N/c1-2-3-4-5-6-23-26(29)15-24-21-11-9-17(13-19(21)10-12-22(24)27(23)30)18-7-8-20(16-31)25(28)14-18/h7-9,11,13-15H,2-6,10,12H2,1H3